%chk=000016090.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016090

0 1
 Br   3.693700       1.035200     -0.1064000    
 C  -0.3737000     -0.2981000      0.2764000    
 C   0.8619000      0.5476000     -5.6600001E-02
 C   -1.660500      0.4090000     -0.1557000    
 C    2.175900     -0.1138000      0.3662000    
 C   -2.895800     -0.4191000      0.1980000    
 C    2.376100      -1.456200     -0.3231000    
 C   -4.177800      0.2954000     -0.1989000    
 H  -0.3259000      -1.265400     -0.2345000    
 H  -0.4014000     -0.4965000       1.354400    
 H   0.8767000      0.7535000      -1.135100    
 H   0.7729000       1.522700      0.4398000    
 H   -1.636500      0.5911000      -1.237000    
 H   -1.723000       1.387700      0.3356000    
 H    2.224700     -0.2297000       1.453600    
 H   -2.851500      -1.389600     -0.3099000    
 H   -2.915300     -0.6175000       1.276000    
 H    2.282700      -1.370600      -1.411600    
 H    3.370900      -1.864700     -0.1103000    
 H    1.652500      -2.199000      2.5599999E-02
 H   -4.204800      0.4825000      -1.277100    
 H   -5.048100     -0.3148000      6.1900001E-02
 H   -4.268600       1.255500      0.3191000    


%chk=000016090-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016090

0 1
Br 3.724449 1.175112 -0.016258
C -0.389253 -0.331916 0.230691
C 0.869003 0.497317 -0.142066
C -1.697466 0.406076 -0.137304
C 2.173209 -0.149563 0.348023
C -2.968871 -0.402941 0.207044
C 2.532667 -1.486810 -0.304151
C -4.270400 0.343865 -0.157325
H -0.368976 -1.311595 -0.286696
H -0.385675 -0.546883 1.319881
H 0.916869 0.632653 -1.240035
H 0.777624 1.506486 0.302271
H -1.694700 0.639931 -1.222260
H -1.729805 1.381257 0.391168
H 2.193539 -0.218444 1.449444
H -2.938219 -1.376005 -0.324429
H -2.968266 -0.639793 1.290656
H 2.581947 -1.389684 -1.402710
H 3.503856 -1.863554 0.057200
H 1.758655 -2.238683 -0.054886
H -4.310838 0.564630 -1.240676
H -5.164881 -0.252761 0.099417
H -4.339367 1.306506 0.383402


